Vitas-M small molecule compound

ethyl 4-[N-(5-chloro-2-methylphenyl)-N-(phenylsulfonyl)glycyl]piperazine-1-carboxylate

Catalog ID
STK327752
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccccc1)c1cc(Cl)ccc1C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H26ClN3O5S MW 479.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClN3O5S/c1-3-31-22(28)25-13-11-24(12-14-25)21(27)16-26(20-15-18(23)10-9-17(20)2)32(29,30)19-7-5-4-6-8-19/h4-10,15H,3,11-14,16H2,1-2H3
InChIKey
ZCHNXTPFROBMEJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=O)CN(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C3=CC=CC=C3
ETHYL4(2(N(BENZENESULFONYL)5CHLORO2METHYLANILINO)ACETYL)PIPERAZINE1CARBOXYLATE
ethyl4(N(5chloro2methylphenyl)N(phenylsulfonyl)glycyl)piperazine1carboxylate
InChI=1SC22H26ClN3O5Sc133122(28)25131124(121425)21(27)1626(201518(23)10917(20)2)32(2930)197546819h41015H3111416H212H3
MFCD02807028
ZINC000009968871
ZINC09968871
ZINC9968871

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.